[(2S)-1-(2,4-dinitroimidazol-1-yl)-3-tri(propan-2-yl)silyloxy-propan-2-yl] (E)-3-phenylprop-2-enoate

Systemtic Name: [(2S)-1-(2,4-dinitroimidazol-1-yl)-3-tri(propan-2-yl)silyloxy-propan-2-yl] (E)-3-phenylprop-2-enoate Openeye Name: [(1S)-1-[(2,4-dinitroimidazol-1-yl)methyl]-2-triisopropylsilyloxy-ethyl] (E)-3-phenylprop-2-enoate CAS Name: (E)-3-phenyl-2-propenoic acid [(2S)-1-(2,4-dinitro-1-imidazolyl)-3-tri(propan-2-yl)silyloxypropan-2-yl] ester IUPAC Name: [(2S)-1-(2,4-dinitroimidazol-1-yl)-3-tri(propan-2-yl)silyloxypropan-2-yl] (E)-3-phenylprop-2-enoate Traditional Name: (E)-3-phenylacrylic acid [(1S)-1-[(2,4-dinitroimidazol-1-yl)methyl]-2-triisopropylsilyloxy-ethyl] ester Formula: C24H34N4O7Si MolecularWeight: 518.63486

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[Si](C(C)C)(C(C)C)OCC(CN1C=C(N=C1[N+](=O)[O-])[N+](=O)[O-])OC(=O)C=CC2=CC=CC=C2

Isomeric SMILES

CC(C)[Si](C(C)C)(C(C)C)OC[C@H](CN1C=C(N=C1[N+](=O)[O-])[N+](=O)[O-])OC(=O)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C24H34N4O7Si/c1-17(2)36(18(3)4,19(5)6)34-16-21(35-23(29)13-12-20-10-8-7-9-11-20)14-26-15-22(27(30)31)25-24(26)28(32)33/h7-13,15,17-19,21H,14,16H2,1-6H3/b13-12+/t21-/m0/s1